data_0-TOPOS_CIWYOY_11T141
_database_code_CSD                  CIWYOY
_audit_creation_date                9/7/2021
_audit_creation_method              ToposPro
_chemical_formula_structural        11T141
_chemical_name_systematic
;
1-(4-phenylbuta-1,3-dien-1-yl)-2-(prop-1-en-1-yl)benzene. 
;
_chemical_formula_sum               ZA0
_citation_journal_abbrev            J.MOL.STRUCT.
_citation_year                      2014
_citation_journal_volume            1065
_citation_page_first                43
_citation_special_details
;
File: search24.cif. 
CENTAT: Sc1
SIMPLIG: ZA=Sc
SIMPPAR: METH=Stan
d; INTRA=V| 
;
loop_
_publ_author_name
'Vuk D.'
'Molcanov K.'
'Skoric I.'
_cell_length_a                      14.0608
_cell_length_b                      5.3605
_cell_length_c                      20.0356
_cell_angle_alpha                   90
_cell_angle_beta                    98.614
_cell_angle_gamma                   90
_cell_volume                        1493.107
_cell_formula_units_Z               4
_symmetry_space_group_name_H-M      'P 21/a'
_symmetry_Int_Tables_number         14
_refine_ls_R_factor_all             0
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 x,y,z
2 1/2-x,1/2+y,-z
3 -x,-y,-z
4 1/2+x,1/2-y,z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
ZA1 ZA 4 0.00845 0.60202 0.26168 1.0000
loop_
_topol_link.node_label_1
_topol_link.node_label_2
_topol_link.distance
_topol_link.site_symmetry_symop_1
_topol_link.site_symmetry_translation_1_x
_topol_link.site_symmetry_translation_1_y
_topol_link.site_symmetry_translation_1_z
_topol_link.site_symmetry_symop_2
_topol_link.site_symmetry_translation_2_x
_topol_link.site_symmetry_translation_2_y
_topol_link.site_symmetry_translation_2_z
_topol_link.type
_topol_link.multiplicity
ZA1 ZA1 11.1845 1 0 0 0 2 0 0 1 v 4
ZA1 ZA1 5.3605 1 0 0 0 1 0 1 0 v 4
ZA1 ZA1 12.1297 1 0 0 0 2 -1 -1 0 v 4
ZA1 ZA1 7.2072 1 0 0 0 4 0 1 0 v 4
ZA1 ZA1 16.8640 1 0 0 0 3 1 0 1 v 2
ZA1 ZA1 7.9793 1 0 0 0 4 0 0 0 v 4
#End of data_0-TOPOS_CIWYOY_11T141